218 citations · 2.9k across the 44 of their papers we have counts for
5 papers · 1 filter
Ceria co-doping: Synergistic or average effect?
Mario Burbano, Sian Nadin, Dario Marrocchelli +2
Ceria (CeO) co-doping has been suggested as a means to achieve ionic conductivities that are significantly higher than those in singly-doped systems. Rekindled interest in th…
Thermal Conductivity of Simple Liquids:Origin of Temperature and Packing Fraction Dependences
Yoshiki Ishii, Keisuke Sato, Mathieu Salanne +2
The origin of both weak temperature dependence and packing fraction dependence of in the thermal conductivity of the simple Lennard-Jones (LJ) liquid is explored.…
The electric double layer has a life of its own
Céline Merlet, David T. Limmer, Mathieu Salanne +4
Using molecular dynamics simulations with recently developed importance sampling methods, we show that the differential capacitance of a model ionic liquid based double-layer capac…
Tuning the Electronic Structure of Anatase Through Fluorination
Dario Corradini, Damien Dambournet, Mathieu Salanne
A highly fluorinated anatase lattice has been recently reported, providing a new class of materials whose general chemical formula is $\rm Ti_{1- \mathit x}\square_{\mathit x}X_{4\…
Effect of dispersion interactions on the properties of LiF in condensed phases
Dario Corradini, Dario Marrocchelli, Paul A. Madden +1
Classical molecular dynamics simulations are performed on LiF in the framework of the polarizable ion model. The overlap-repulsion and polarization terms of the interaction potenti…